2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(methyl)amino]ethanoic acid

Systemtic Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(methyl)amino]ethanoic acid Openeye Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(methyl)amino]acetic acid CAS Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(methyl)amino]acetic acid IUPAC Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(methyl)amino]acetic acid Traditional Name: 2-[3,4-dihydro-1H-isoquinolin-2-ylsulfonyl(methyl)amino]acetic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)S(=O)(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CN(CC(=O)O)S(=O)(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C12H16N2O4S/c1-13(9-12(15)16)19(17,18)14-7-6-10-4-2-3-5-11(10)8-14/h2-5H,6-9H2,1H3,(H,15,16)